F37

(5S)-5-methyl-5-[4-(4-oxidanylidene-3H-quinazolin-2-yl)phenyl]imidazolidine-2,4-dione

Created: 2013-06-24
Last modified:  2014-09-05

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Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count1
Bond Count42
Aromatic Bond Count12
2D diagram of F37

Chemical Component Summary

Name(5S)-5-methyl-5-[4-(4-oxidanylidene-3H-quinazolin-2-yl)phenyl]imidazolidine-2,4-dione
Systematic Name (OpenEye OEToolkits)(5S)-5-methyl-5-[4-(4-oxidanylidene-3H-quinazolin-2-yl)phenyl]imidazolidine-2,4-dione
FormulaC18 H14 N4 O3
Molecular Weight334.329
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C1c4ccccc4N=C(N1)c2ccc(cc2)C3(C(=O)NC(=O)N3)C
SMILESCACTVS3.385C[C]1(NC(=O)NC1=O)c2ccc(cc2)C3=Nc4ccccc4C(=O)N3
SMILESOpenEye OEToolkits1.9.2CC1(C(=O)NC(=O)N1)c2ccc(cc2)C3=Nc4ccccc4C(=O)N3
Canonical SMILESCACTVS3.385 C[C@]1(NC(=O)NC1=O)c2ccc(cc2)C3=Nc4ccccc4C(=O)N3
Canonical SMILESOpenEye OEToolkits1.9.2 C[C@@]1(C(=O)NC(=O)N1)c2ccc(cc2)C3=Nc4ccccc4C(=O)N3
InChIInChI1.03 InChI=1S/C18H14N4O3/c1-18(16(24)21-17(25)22-18)11-8-6-10(7-9-11)14-19-13-5-3-2-4-12(13)15(23)20-14/h2-9H,1H3,(H,19,20,23)(H2,21,22,24,25)/t18-/m0/s1
InChIKeyInChI1.03 SBPOIJPCJCMVPV-SFHVURJKSA-N

Related Resource References

Resource NameReference
PubChem 135566664, 71748656